[1-oxidanylidene-1-(4-phenylbutan-2-ylamino)propan-2-yl] 2-azanyl-3,5-bis(chloranyl)benzoate

Systemtic Name: [1-oxidanylidene-1-(4-phenylbutan-2-ylamino)propan-2-yl] 2-azanyl-3,5-bis(chloranyl)benzoate Openeye Name: [1-methyl-2-[(1-methyl-3-phenyl-propyl)amino]-2-oxo-ethyl] 2-amino-3,5-dichloro-benzoate CAS Name: 2-amino-3,5-dichlorobenzoic acid [1-oxo-1-(4-phenylbutan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylbutan-2-ylamino)propan-2-yl] 2-amino-3,5-dichlorobenzoate Traditional Name: 2-amino-3,5-dichloro-benzoic acid [2-keto-1-methyl-2-[(1-methyl-3-phenyl-propyl)amino]ethyl] ester Formula: C20H22Cl2N2O3 MolecularWeight: 409.30628

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC(=CC(=C2N)Cl)Cl

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC(=CC(=C2N)Cl)Cl

InChI

InChI=1S/C20H22Cl2N2O3/c1-12(8-9-14-6-4-3-5-7-14)24-19(25)13(2)27-20(26)16-10-15(21)11-17(22)18(16)23/h3-7,10-13H,8-9,23H2,1-2H3,(H,24,25)